EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H21N5O3S |
| Net Charge | 0 |
| Average Mass | 411.487 |
| Monoisotopic Mass | 411.13651 |
| SMILES | CS(=O)(=O)Nc1ccc(Cc2noc(-c3ccc4ncc(CCN)c4c3)n2)cc1 |
| InChI | InChI=1S/C20H21N5O3S/c1-29(26,27)25-16-5-2-13(3-6-16)10-19-23-20(28-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22,25H,8-10,21H2,1H3 |
| InChIKey | HKXMQLISPYELRD-UHFFFAOYSA-N |
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